⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7963079 | 0.78 | HDAC3 (0.34) | — | |
| SCHEMBL7963080 | 0.78 | HDAC3 (0.34) | — | |
| SCHEMBL600809 | 0.76 | ALDH1A1 (0.40) | — | |
| SCHEMBL600808 | 0.76 | ALDH1A1 (0.40) | — | |
| SCHEMBL1275353 | 0.75 | HCAR2 (0.35) | — | |
| SCHEMBL6034821 | 0.73 | TSHR (0.41) | — | |
| SCHEMBL16212611 | 0.73 | HDAC3 (0.40) | — | |
| SCHEMBL8600596 | 0.69 | HDAC3 (0.40) | — | |
| SCHEMBL1274513 | 0.68 | CES1 (0.36) | — | |
| SCHEMBL6263184 | 0.67 | HDAC3 (0.39) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1385637-A4 | IMPROVED RAMAN-ACTIVE TAGGANTS AND THEIR RECOGNITION | QUANTAG SYSTEMS INC (US) | 2006-10-18 | — | — | EP | disclosed |
| US-20040058058-A1 | Prefatory anti-forgery protection and consecutive machine-assisted authentication of genuine documents and other values | SHCHEGOLIKHIN ALEXANDER NIKITO (RU) | 2004-03-25 | — | — | US | disclosed |
| EP-1385637-A1 | IMPROVED RAMAN-ACTIVE TAGGANTS AND THEIR RECOGNITION | Quantag Systems, Inc. (US) | 2004-02-04 | — | — | EP | disclosed |
| US-6610351-B2 | Spectroscopy | QUANTAG SYSTEMS, INC. | 2003-08-26 | — | — | US | disclosed |
| WO-2002085543-A1 | IMPROVED RAMAN-ACTIVE TAGGANTS AND THEIR RECOGNITION | QUANTAG SYSTEMS, INC. (US) | 2002-10-31 | — | — | WO | disclosed |
| US-20020025490-A1 | Spectroscopy | CHROMATIC TECHNOLOGIES, INC. | 2002-02-28 | — | — | US | disclosed |